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114396-70-2 | L-Serine, 2-methyl-N-[(phenylmethoxy)carbonyl]-
CAS No: 114396-70-2 Catalog No: AG000B84 MDL No:
Product Description
Catalog Number:
AG000B84
Chemical Name:
L-Serine, 2-methyl-N-[(phenylmethoxy)carbonyl]-
CAS Number:
114396-70-2
Molecular Formula:
C12H15NO5
Molecular Weight:
253.2512
IUPAC Name:
(2S)-3-hydroxy-2-methyl-2-(phenylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C12H15NO5/c1-12(8-14,10(15)16)13-11(17)18-7-9-5-3-2-4-6-9/h2-6,14H,7-8H2,1H3,(H,13,17)(H,15,16)/t12-/m0/s1
InChI Key:
QPGOJGJGAWHTFS-LBPRGKRZSA-N
SMILES:
OC[C@@](C(=O)O)(NC(=O)OCc1ccccc1)C
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
253.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
253.254g/mol
Monoisotopic Mass:
253.095g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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